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Computer simulation of fluid phase transitions

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 نشر من قبل Nigel B. Wilding
 تاريخ النشر 2001
  مجال البحث فيزياء
والبحث باللغة English
 تأليف N.B. Wilding




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The task of accurately locating fluid phase boundaries by means of computer simulation is hampered by problems associated with sampling both coexisting phases in a single simulation run. We explain the physical background to these problems and describe how they can be tackled using a synthesis of biased Monte Carlo sampling and histogram extrapolation methods, married to a standard fluid simulation algorithm. It is demonstrated that the combined approach provides a powerful method for tracing fluid phase boundaries.



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